1-ethyl-1,7-diazaspiro[3.5]nonane

C9H18N2 — CID 134069783

IUPAC1-ethyl-1,7-diazaspiro[3.5]nonane
SMILESCCN1CCC12CCNCC2
InChIInChI=1S/C9H18N2/c1-2-11-8-5-9(11)3-6-10-7-4-9/h10H,2-8H2,1H3
InChIKeyQRTUXOAVWNSYRC-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.83
Rot. Bonds1

About 1-ethyl-1,7-diazaspiro[3.5]nonane

1-ethyl-1,7-diazaspiro[3.5]nonane (PubChem CID 134069783) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 1-ethyl-1,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name1-ethyl-1,7-diazaspiro[3.5]nonane
PubChem CID134069783
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name1-ethyl-1,7-diazaspiro[3.5]nonane
SMILESCCN1CCC12CCNCC2
InChIInChI=1S/C9H18N2/c1-2-11-8-5-9(11)3-6-10-7-4-9/h10H,2-8H2,1H3
InChIKeyQRTUXOAVWNSYRC-UHFFFAOYSA-N
XLogP0.83
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1,7-diazaspiro[3.5]nonane?
The IUPAC name of 1-ethyl-1,7-diazaspiro[3.5]nonane (CID 134069783) is 1-ethyl-1,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 1-ethyl-1,7-diazaspiro[3.5]nonane?
The canonical SMILES for 1-ethyl-1,7-diazaspiro[3.5]nonane is CCN1CCC12CCNCC2.
What is the InChIKey of 1-ethyl-1,7-diazaspiro[3.5]nonane?
The InChIKey is QRTUXOAVWNSYRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-2-11-8-5-9(11)3-6-10-7-4-9/h10H,2-8H2,1H3.
What are the key properties of 1-ethyl-1,7-diazaspiro[3.5]nonane?
1-ethyl-1,7-diazaspiro[3.5]nonane has a molecular weight of 154.26 g/mol, XLogP of 0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 134069783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).